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Substance Name: Benzoic acid, 2-((4-bis(2-iodoethyl)amino-2-methyl)phenyl)azo-
RN: 40136-89-8
InChIKey: QFQHSEVSDPSZRN-QURGRASLSA-N

Molecular Formula

  • C18-H19-I2-N3-O2

Molecular Weight

  • 563.167
 
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Names and Synonyms

Synonyms

  • Azobenzene, 4-bis(2-iodoethyl)amino-2'-carboxy-2-methyl-
  • Benzoic acid, 2-((4-bis(2-iodoethyl)amino)-1-(o-tolyl))azo-
  • NSC 240421

Systematic Name

  • Benzoic acid, 2-((4-bis(2-iodoethyl)amino-2-methyl)phenyl)azo-

Registry Numbers

CAS Registry Number

  • 40136-89-8

System Generated Number

  • 0040136898

Structure Descriptors

InChI

1S/C18H19I2N3O2/c1-13-12-14(23(10-8-19)11-9-20)6-7-16(13)21-22-17-5-3-2-4-15(17)18(24)25/h2-7,12H,8-11H2,1H3,(H,24,25)/b22-21+

InChIKey

QFQHSEVSDPSZRN-QURGRASLSA-N

Smiles

c1(N(CCI)CCI)cc(c(\N=N\c2c(cccc2)C(O)=O)cc1)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 36mg/kg (36mg/kg)   Journal of the National Cancer Institute. Vol. 50, Pg. 243, 1973.